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canSAR1829620
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NAMES
    SMILES
    CC1(C(=O)Nc2ccc3c(c2)OCCO3)CCN1Cc1ccc(-c2ccccn2)cc1
    InChI
    InChI=1S/C25H25N3O3/c1-25(24(29)27-20-9-10-22-23(16-20)31-15-14-30-22)11-13-28(25)17-18-5-7-19(8-6-18)21-4-2-3-12-26-21/h2-10,12,16H,11,13-15,17H2,1H3,(H,27,29)
    MOLECULAR FORMULA
    C25H25N3O3
    CROSS REFERENCES
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    canSAR1829620

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 415.19
    AlogP 4.12
    HBond donors 1
    HBond acceptors 6
    Atoms 56
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1829620.